| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
A |
50 |
17 |
7325 |
◊ |
B |
-x-1/2,-y+2,z-1/2 |
2_474 |
62 |
16 |
7259 |
568.2 |
-0.2 |
0.520 |
6 |
5 |
0 |
0.000 |
2 |
|
A |
59 |
15 |
7325 |
◊ |
B |
-x+1/2,-y+2,z-1/2 |
2_574 |
49 |
16 |
7259 |
540.9 |
0.3 |
0.568 |
0 |
5 |
0 |
0.000 |
| Average: |
554.6 |
0.1 |
0.544 |
3 |
5 |
0 |
0.000 |
| 2 |
3 |
|
[A1R]A:201 |
34 |
1 |
683 |
f |
A |
x,y,z |
1_555 |
68 |
23 |
7325 |
441.6 |
-6.2 |
0.316 |
5 |
0 |
0 |
0.232 |
| 3 |
4 |
|
[A1R]B:201 |
33 |
1 |
697 |
f |
B |
x,y,z |
1_555 |
69 |
26 |
7259 |
439.4 |
-5.1 |
0.359 |
5 |
0 |
0 |
0.200 |
| 4 |
5 |
|
B |
47 |
13 |
7259 |
◊ |
A |
x,y,z |
1_555 |
51 |
14 |
7325 |
426.6 |
1.0 |
0.649 |
4 |
1 |
0 |
0.025 |
| 5 |
6 |
|
B |
14 |
6 |
7259 |
◊ |
A |
x-1,y,z |
1_455 |
13 |
7 |
7325 |
141.8 |
-1.4 |
0.333 |
0 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
15 |
4 |
7325 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
16 |
4 |
7259 |
139.1 |
0.1 |
0.532 |
0 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[EDO]A:205 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
7325 |
109.8 |
4.0 |
0.631 |
2 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[EDO]B:205 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
7259 |
108.5 |
4.2 |
0.477 |
2 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[EDO]B:203 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
7259 |
106.8 |
4.0 |
0.602 |
1 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[EDO]A:204 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
7325 |
106.7 |
4.0 |
0.619 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[A1R]A:201 |
14 |
1 |
683 |
◊ |
B |
-x-1/2,-y+2,z-1/2 |
2_474 |
13 |
3 |
7259 |
99.9 |
1.0 |
0.732 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[EDO]A:206 |
4 |
1 |
185 |
cf |
A |
x,y,z |
1_555 |
12 |
4 |
7325 |
86.2 |
1.9 |
0.253 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
A |
13 |
6 |
7325 |
◊ |
[EDO]B:206 |
-x+1/2,-y+2,z-1/2 |
2_574 |
4 |
1 |
183 |
74.0 |
1.8 |
0.214 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
[EDO]B:204 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
7259 |
69.4 |
2.8 |
0.313 |
1 |
0 |
0 |
0.000 |
| 15 |
16 |
|
B |
8 |
4 |
7259 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
2 |
7325 |
60.3 |
-0.4 |
0.453 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[CL]B:202 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
7259 |
54.9 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.501 |
18 |
|
[CL]A:202 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
7325 |
54.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.501 |
| Average: |
54.8 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.501 |
| 17 |
19 |
|
A |
5 |
3 |
7325 |
◊ |
[A1R]B:201 |
-x+1/2,-y+2,z-1/2 |
2_574 |
7 |
1 |
697 |
50.1 |
0.2 |
0.691 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[CL]A:203 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
7325 |
49.0 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.359 |
21 |
|
[CL]A:203 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
7259 |
48.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.359 |
| Average: |
48.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.359 |
| 19 |
22 |
|
[CL]B:202 |
1 |
1 |
125 |
f |
[A1R]B:201 |
x,y,z |
1_555 |
3 |
1 |
697 |
27.7 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.128 |
23 |
|
[CL]A:202 |
1 |
1 |
125 |
f |
[A1R]A:201 |
x,y,z |
1_555 |
3 |
1 |
683 |
27.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.128 |
| Average: |
27.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.128 |
| 20 |
24 |
|
[EDO]B:206 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
7259 |
27.0 |
0.8 |
0.901 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
B |
3 |
1 |
7259 |
x |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
3 |
1 |
7259 |
26.6 |
0.4 |
0.721 |
0 |
1 |
0 |
0.000 |
| 22 |
26 |
|
[EDO]A:206 |
2 |
1 |
185 |
◊ |
[A1R]B:201 |
-x+1/2,-y+2,z-1/2 |
2_574 |
3 |
1 |
697 |
15.5 |
-0.0 |
0.659 |
0 |
0 |
0 |
0.000 |
| 23 |
27 |
|
[EDO]B:204 |
1 |
1 |
185 |
f |
A |
x-1,y,z |
1_455 |
2 |
1 |
7325 |
14.3 |
0.0 |
0.627 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
A |
1 |
1 |
7325 |
◊ |
[CL]B:202 |
-x+1/2,-y+2,z-1/2 |
2_574 |
1 |
1 |
125 |
7.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
|
[CL]A:202 |
1 |
1 |
125 |
◊ |
B |
-x-1/2,-y+2,z-1/2 |
2_474 |
1 |
1 |
7259 |
7.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
7.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
|